Compound Identification
SMILES
CC1(C)COC(=O)[C@H]1NC(=O)[C@@H](CC(O)=O)C1=CN(C=C1)C1=CC=C(C=C1)C1=CC=C(C=C1)C#N
InChIKey
InChIKey=GYKMAWIYKPLMGN-LADGPHEKSA-N
Formula
C27H25N3O5
Mass
471.513
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Benzenoids
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Class
Benzene and substituted derivatives
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Subclass
Biphenyls and derivatives
- Level 5 Biphenylcarbonitriles
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Subclass
Biphenyls and derivatives
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Biphenyls and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Biphenylcarbonitriles
Alternative Parents
Alpha amino acid esters N-acyl-alpha amino acids and derivatives Acyl-L-homoserine lactones Phenylpyrroles Benzonitriles N-acyl amines Gamma butyrolactones Dicarboxylic acids and derivatives Oxolanes Heteroaromatic compounds Secondary carboxylic acid amides Carboxylic acid esters Oxacyclic compounds Azacyclic compounds Nitriles Carboxylic acids Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Biphenylcarbonitrile - Alpha-amino acid ester - N-acyl-alpha amino acid or derivatives - Acyl-homoserine lactone - Acyl-l-homoserine lactone - 1-phenylpyrrole - Alpha-amino acid or derivatives - Benzonitrile - N-acyl-amine - Gamma butyrolactone - Fatty acyl - Dicarboxylic acid or derivatives - Substituted pyrrole - Fatty amide - Heteroaromatic compound - Oxolane - Pyrrole - Carboxylic acid ester - Secondary carboxylic acid amide - Carboxamide group - Lactone - Oxacycle - Carboxylic acid derivative - Azacycle - Carboxylic acid - Organoheterocyclic compound - Nitrile - Carbonitrile - Organic oxygen compound - Organic nitrogen compound - Cyanide - Organic oxide - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Carbonyl group - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as biphenylcarbonitriles. These are organic compounds containing an acetonitrile with one hydrogen replaced by a biphenyl group.
External Descriptors
Not available